3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y205-9768 |
| Compound Name: | 3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 355.77 |
| Molecular Formula: | C16 H18 Cl N O6 |
| Smiles: | COc1cc(c(cc1NC(C1C(C2CCC1O2)C(O)=O)=O)OC)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7705 |
| logD: | 1.2546 |
| logSw: | -3.6956 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.925 |
| InChI Key: | FIJMPRXDDDDTNH-UHFFFAOYSA-N |